thymidine [Ligand Id: 4718] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL52609 (Thymidin, NSC-21548, Zidovudine related compound d rs, Thymidine, Zidovudine related compound d, Thymidinedeoxyriboside)
  • ATPase family AAA domain containing 2/ATPase family AAA domain-containing protein 2 in Human [ChEMBL: CHEMBL2150837] [GtoPdb: 2719] [UniProtKB: Q6PL18]
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  • Thymidine kinase in Human herpesvirus 1 (strain SC16) (HHV-1) (Human herpes simplex virus1) [ChEMBL: CHEMBL1820] [UniProtKB: P06479]
  • Thymidine kinase in Macacine herpesvirus 1 [ChEMBL: CHEMBL1075062] [UniProtKB: A3RLP8]
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  • Thymidylate kinase in Mycobacterium tuberculosis [ChEMBL: CHEMBL2361] [UniProtKB: P9WKE1]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
ATPase family AAA domain containing 2/ATPase family AAA domain-containing protein 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2150837] [GtoPdb: 2719] [UniProtKB: Q6PL18]
ChEMBL Binding affinity to recombinant human ATAD2 (982 to 1108 amino acids) bromodomain radiolabelled at methyl groups of leucine, valine, isoleucine, methionine expressed in Escherichia coli BL21 (DE3) by NMR titration B 2 pKd 10000000 nM Kd MedChemComm (2014) 5: 1843-1848
Thymidine kinase in Human herpesvirus 1 (strain SC16) (HHV-1) (Human herpes simplex virus1) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1820] [UniProtKB: P06479]
ChEMBL Binding affinity towards HSV-1 thymidine kinase B 6 pIC50 1000 nM IC50 J. Med. Chem. (1996) 39: 4727-4737 [PMID:8941385]
Thymidine kinase in Macacine herpesvirus 1 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075062] [UniProtKB: A3RLP8]
ChEMBL Inhibition of Herpes B virus recombinant thymidine kinase-mediated [3H]TdR phosphorylation B 5.39 pIC50 4100 nM IC50 Antimicrob. Agents Chemother. (2007) 51: 2028-2034 [PMID:17438061]
Thymidine kinase, cytosolic in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2883] [UniProtKB: P04183]
ChEMBL Inhibition of HSV-1 thymidine kinase B 5.7 pKi 2000 nM Ki J. Med. Chem. (1992) 35: 4214-4220 [PMID:1331461]
ChEMBL Binding affinity constant against HSV-1 thymidine kinase B 6.7 pKi 200 nM Ki J. Med. Chem. (2003) 46: 5045-5054 [PMID:14584954]
ChEMBL Inhibitory concentration against HSV-1 TK (WT) catalyzed [3H]-GCV phosphorylation F 5.74 pIC50 1800 nM IC50 J. Med. Chem. (2002) 45: 4254-4263 [PMID:12213066]
ChEMBL Inhibitory activity (50 uM) against HSV-1 Thymidine kinase in OST-TK-/HSV-1 TK+ cell line in combination with gancicclovir B 7.59 pIC50 26 nM IC50 J. Med. Chem. (2002) 45: 4254-4263 [PMID:12213066]
ChEMBL Inhibitory activity (50 uM) against HSV-1 Thymidine kinase in OST-TK-/HSV-1 TK+ cell line in combination with BVAraU B 7.8 pIC50 16 nM IC50 J. Med. Chem. (2002) 45: 4254-4263 [PMID:12213066]
Thymidylate kinase in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2361] [UniProtKB: P9WKE1]
ChEMBL Inhibitory activity against thymidine monophosphate kinase (TMPK) in Mycobacterium tuberculosis B 4.57 pKi 27000 nM Ki Bioorg. Med. Chem. Lett. (2003) 13: 3045-3048 [PMID:12941330]
ChEMBL In Vitro inhibition of Thymidine Monophosphatase Kinase of Mycobacterium tuberculosis (TMPKm) B 4.57 pKi 27000 nM Ki J. Med. Chem. (2003) 46: 3811-3821 [PMID:12930144]
ChEMBL Binding affinity towards mycobacterium tuberculosis thymidine monophosphate kinase B 4.57 pKi 27000 nM Ki J. Med. Chem. (2005) 48: 2457-2468 [PMID:15801836]
ChEMBL Inhibition of Mycobacterium tuberculosis TMPK by coupled spectrophotometric assay B 4.57 pKi 27000 nM Ki J. Med. Chem. (2004) 47: 6187-6194 [PMID:15566289]
ChEMBL Inhibition of Mycobacterium tuberculosis recombinant TMPK B 4.57 pKi 27000 nM Ki Bioorg. Med. Chem. (2008) 16: 6075-6085 [PMID:18467107]
ChEMBL Inhibition of Mycobacterium tuberculosis TMPK using dTMP substrate and NADH by pyruvate kinase/lactate dehydrogenase coupling system based spectrophotometric assay B 4.57 pKi 27000 nM Ki US-20080096907-A1. Aryl, Pyrimidyl Compounds, Pharmaceutical Compositions Comprising them, Their Use as Antimicrobial Agents (2008)

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]